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Ligand · 8HN

8HN · 2-[(2~{S})-1-[3-cyano-7-[(2-oxidanylidene-3,4-dihydro-1~{H}-quinolin-6-yl)amino]pyrazolo[1,5-a]pyrimidin-5-yl]pyrrolidin-2-yl]ethanoic acid

8HN, 2-[(2~{S})-1-[3-cyano-7-[(2-oxidanylidene-3,4-dihydro-1~{H}-quinolin-6-yl)amino]pyrazolo[1,5-a]pyrimidin-5-yl]pyrrolidin-2-yl]ethanoic acid (C22 H21 N7 O3, 431.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
8HN
Formula
C22 H21 N7 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

8HN in 2 structures; the first of them:

  • 5N21 · Crystal structure of the BCL6 BTB domain in complex with pyrazolo-pyrimidine ligand · 8HN A202 · binds MET51, ALA52, CYS53, SER54, GLY55, TYR58, GLN113, MET114 and 6 more
  • 5N21 · Crystal structure of the BCL6 btb domain in complex with pyrazolo- pyrimidine ligand · 8HN A202 · binds MET51, ALA52, CYS53, SER54, GLY55, TYR58, GLN113, MET114 and 5 more

Residues it binds most

ARG 4, MET 4, ALA 4, ASN 4, CYS 4, GLN 4, GLU 4, GLY 4, LEU 4, SER 4 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion

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